0 mol 1 unq 0 iso 0 dist 9.76602 9.77112 7.46399 11.3817 3.81243 9.84681 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 9.27409 5.73909 9.81193 10.2405 5.8481 8.16183 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 7.07989 7.13073 6.34966 13.8524 9.87177 7.95428 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 7.07989 7.13073 6.34966 10.7153 7.71726 5.88256 numMergedOcc 0
4 mol 68 unq 2 iso 0 dist 9.77272 13.7884 6.34966 18.9548 9.87177 7.95428 numMergedOcc 0
5 mol 68 unq 3 iso 0 dist 9.77272 13.7884 6.34966 17.2731 7.71726 5.88256 numMergedOcc 0
6 mol 116 unq 0 iso 0 dist 7.6005 5.17486 6.63731 9.87191 3.82942 8.75205 numMergedOcc 0
7 mol 116 unq 1 iso 0 dist 8.7583 6.28627 6.63731 9.21528 3.82942 8.75205 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 7.6793 5.05068 6.37143 5.56446 9.84473 7.11411 numMergedOcc 0
9 mol 206 unq 0 iso 0 dist 8.15381 4.58247 6.69623 8.79378 5.70985 5.83021 numMergedOcc 0
10 mol 206 unq 1 iso 0 dist 8.15381 9.70849 6.21951 8.79378 5.70985 9.18711 numMergedOcc 0
11 mol 214 unq 0 iso 0 dist 8.7085 7.33956 7.43301 10.3706 3.91276 5.79617 numMergedOcc 0
12 mol 219 unq 0 iso 0 dist 7.13099 6.90398 9.30312 6.52136 5.75906 8.38773 numMergedOcc 0
13 mol 223 unq 0 iso 0 dist 7.81769 5.59816 6.64193 14.1948 10.5752 8.85178 numMergedOcc 0
14 mol 223 unq 1 iso 0 dist 7.81769 5.59816 6.64193 9.6936 3.86668 9.73123 numMergedOcc 0
15 mol 223 unq 2 iso 0 dist 7.66694 4.04961 6.64193 11.4037 10.5752 8.85178 numMergedOcc 0
16 mol 223 unq 3 iso 0 dist 7.66694 4.04961 6.64193 9.36733 3.86668 9.73123 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 9.79381 4.73362 6.6069 11.0725 5.8463 9.0735 numMergedOcc 0
18 mol 225 unq 1 iso 0 dist 8.37379 6.31615 6.6069 9.49163 5.8463 9.0735 numMergedOcc 0
19 mol 285 unq 0 iso 0 dist 8.60489 6.52069 8.35007 11.0651 8.85284 6.5354 numMergedOcc 0
20 mol 285 unq 1 iso 0 dist 8.76332 6.52069 8.02964 11.0651 6.3633 6.5354 numMergedOcc 0
